2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide
The title molecule, C23H19ClN4O2S, is in an `extended' conformation. In the crystal, pairwise N—H...N and C—H...O hydrogen bonds lead to the formation of `stair-step' chains. C—H...π interactions further contribute to the consolidation of the molecular packing. The 4-chlorophenyl group is...
| Main Authors: | , , , , |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2016-03-01
|
| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616004533 |
| _version_ | 1811315847944208384 |
|---|---|
| author | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Etify A. Bakhite Mustafa R. Albayati |
| author_facet | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Etify A. Bakhite Mustafa R. Albayati |
| author_sort | Joel T. Mague |
| collection | DOAJ |
| description | The title molecule, C23H19ClN4O2S, is in an `extended' conformation. In the crystal, pairwise N—H...N and C—H...O hydrogen bonds lead to the formation of `stair-step' chains. C—H...π interactions further contribute to the consolidation of the molecular packing. The 4-chlorophenyl group is disordered over two sets of sites in a 0.948 (2):0.052 (2) ratio. The dihedral angle between the two components of the disordered chloro-substituted benzene ring is 15.76 (9) °. |
| first_indexed | 2024-04-13T11:37:30Z |
| format | Article |
| id | doaj.art-786adeb6a207442f8a971de8ceb858a5 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-04-13T11:37:30Z |
| publishDate | 2016-03-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-786adeb6a207442f8a971de8ceb858a52022-12-22T02:48:23ZengInternational Union of CrystallographyIUCrData2414-31462016-03-0113x16045310.1107/S2414314616004533rz40022-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamideJoel T. Mague0Shaaban K. Mohamed1Mehmet Akkurt2Etify A. Bakhite3Mustafa R. Albayati4Department of Chemistry, Tulane University, New Orleans, LA 70118, USAChemistry and Environmental Division, Manchester Metropolitan University, Manchester M1 5GD, EnglandDepartment of Physics, Faculty of Sciences, Erciyes University, 38039 Kayseri, TurkeyChemistry Department, Faculty of Science, Assiut University, Assiut 71516, EgyptKirkuk University, College of Science, Department of Chemistry, Kirkuk, IraqThe title molecule, C23H19ClN4O2S, is in an `extended' conformation. In the crystal, pairwise N—H...N and C—H...O hydrogen bonds lead to the formation of `stair-step' chains. C—H...π interactions further contribute to the consolidation of the molecular packing. The 4-chlorophenyl group is disordered over two sets of sites in a 0.948 (2):0.052 (2) ratio. The dihedral angle between the two components of the disordered chloro-substituted benzene ring is 15.76 (9) °.http://scripts.iucr.org/cgi-bin/paper?S2414314616004533crystal structuretriazolesphenoxidesamides |
| spellingShingle | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Etify A. Bakhite Mustafa R. Albayati 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide IUCrData crystal structure triazoles phenoxides amides |
| title | 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide |
| title_full | 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide |
| title_fullStr | 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide |
| title_full_unstemmed | 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide |
| title_short | 2-({5-[(4-Chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide |
| title_sort | 2 5 4 chlorophenoxy methyl 4 phenyl 4h 1 2 4 triazol 3 yl sulfanyl n phenylacetamide |
| topic | crystal structure triazoles phenoxides amides |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616004533 |
| work_keys_str_mv | AT joeltmague 254chlorophenoxymethyl4phenyl4h124triazol3ylsulfanylnphenylacetamide AT shaabankmohamed 254chlorophenoxymethyl4phenyl4h124triazol3ylsulfanylnphenylacetamide AT mehmetakkurt 254chlorophenoxymethyl4phenyl4h124triazol3ylsulfanylnphenylacetamide AT etifyabakhite 254chlorophenoxymethyl4phenyl4h124triazol3ylsulfanylnphenylacetamide AT mustafaralbayati 254chlorophenoxymethyl4phenyl4h124triazol3ylsulfanylnphenylacetamide |